4-tert-butyl-N-[2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]benzamide Openeye Name: 4-tert-butyl-N-[2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]benzamide CAS Name: 4-tert-butyl-N-[2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-1-oxoethyl]benzamide IUPAC Name: 4-tert-butyl-N-[2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]benzamide Traditional Name: 4-tert-butyl-N-[2-[(4-butyl-5-keto-1H-1,2,4-triazol-3-yl)thio]acetyl]benzamide Formula: C19H26N4O3S MolecularWeight: 390.49974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SCC(=O)NC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCCCN1C(=O)NN=C1SCC(=O)NC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C19H26N4O3S/c1-5-6-11-23-17(26)21-22-18(23)27-12-15(24)20-16(25)13-7-9-14(10-8-13)19(2,3)4/h7-10H,5-6,11-12H2,1-4H3,(H,21,26)(H,20,24,25)